Match comparison for Multipoles [step 83] (match type 30956)
Commits >
Commit 6dda27ed08cd9fd2b2f861e6109ead2bd6d3cd56 >
Input 23-td_qedft_breit_pxlda_adiabatic.03-td_restart.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| 5.517961618581718e-04 | 1.400000000000000e-13 | 5.517961618768054e-04 | 8.099540885217503e-14 | 5.517961618581718e-04 | 1.269280362238556e-13 | PASS |
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Detailed information
Reference: 0.0005517961618581718, precision: 0.00000000000014| Run | Value | Difference | Relative difference | Status |
| foss_cmake: [foss2022a-serial, foss-min] | 5.517961619328828e-04 | 7.471096224315188e-14 | 5.336497303082277e-01 | PASS |
| foss_min_autotools: [foss2022a-serial] | 5.517961619328828e-04 | 7.471096224315188e-14 | 5.336497303082277e-01 | PASS |
| foss_cmake: [foss2022a-serial, foss-full] | 5.517961619217391e-04 | 6.356720705369412e-14 | 4.540514789549580e-01 | PASS |
| foss_min_autotools: [foss2023a-serial] | 5.517961619328828e-04 | 7.471096224315188e-14 | 5.336497303082277e-01 | PASS |
| foss_min_autotools: [foss2023b-serial] | 5.517961619328828e-04 | 7.471096224315188e-14 | 5.336497303082277e-01 | PASS |
| foss_autotools: [foss2022a-serial] | 5.517961619328828e-04 | 7.471096224315188e-14 | 5.336497303082277e-01 | PASS |
| foss_autotools: [foss2023a-serial] | 5.517961619328828e-04 | 7.471096224315188e-14 | 5.336497303082277e-01 | PASS |
| foss_opt_autotools: [foss2023a-serial] | 5.517961619328828e-04 | 7.471096224315188e-14 | 5.336497303082277e-01 | PASS |
| intel_autotools: [intel2023a-serial] | 5.517961618729663e-04 | 1.479448074465095e-14 | 1.056748624617925e-01 | PASS |
| foss_cmake: [foss2022a-mpi, foss-min-mpi] | 5.517961619850999e-04 | 1.269280904339642e-13 | 9.066292173854589e-01 | PASS |
| foss_cmake: [foss2023a-mpi, foss-min-mpi] | 5.517961619850999e-04 | 1.269280904339642e-13 | 9.066292173854589e-01 | PASS |
| foss_cmake: [foss2022a-mpi, foss-full-mpi] | 5.517961617531895e-04 | -1.049823205798162e-13 | -7.498737184272583e-01 | PASS |
| foss_mpi_min_autotools: [foss2023a-mpi] | 5.517961619850999e-04 | 1.269280904339642e-13 | 9.066292173854589e-01 | PASS |
| foss_mpi_min_autotools: [foss2022a-mpi] | 5.517961619850999e-04 | 1.269280904339642e-13 | 9.066292173854589e-01 | PASS |
| foss_cmake: [foss2023a-mpi, foss-full-mpi] | 5.517961617531895e-04 | -1.049823205798162e-13 | -7.498737184272583e-01 | PASS |
| foss_autotools: [foss2023b-serial] | 5.517961619328828e-04 | 7.471096224315188e-14 | 5.336497303082277e-01 | PASS |
| foss_omp_autotools: [foss2023a-serial] | 5.517961617368318e-04 | -1.213400040167567e-13 | -8.667143144054050e-01 | PASS |
| foss_mpi_opt_autotools: [foss2023a-mpi] | 5.517961618063907e-04 | -5.178117049725595e-14 | -3.698655035518282e-01 | PASS |
| foss_mpi_autotools: [foss2022a-mpi] | 5.517961618063907e-04 | -5.178117049725595e-14 | -3.698655035518282e-01 | PASS |
| foss_mpi_autotools: [foss2023a-mpi] | 5.517961618063907e-04 | -5.178117049725595e-14 | -3.698655035518282e-01 | PASS |
| intel_omp_autotools: [intel2022a-serial] | 5.517961617312439e-04 | -1.269279820137470e-13 | -9.066284429553356e-01 | PASS |
| intel_omp_autotools: [intel2023a-serial] | 5.517961617312439e-04 | -1.269279820137470e-13 | -9.066284429553356e-01 | PASS |
| foss_ppc_autotools: [foss2022a-serial] | 5.517961619307169e-04 | 7.254505156317759e-14 | 5.181789397369827e-01 | PASS |
| foss_debug_autotools: [foss2023a-serial] | 5.517961619328828e-04 | 7.471096224315188e-14 | 5.336497303082277e-01 | PASS |
| foss_cuda_autotools: [foss2022a-cuda-mpi] | 5.517961618898966e-04 | 3.172473134888110e-14 | 2.266052239205792e-01 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | 5.517961618268059e-04 | -3.136596885000564e-14 | -2.240426346428974e-01 | PASS |
| foss_mpi_debug_autotools: [foss2023a-mpi] | 5.517961618063907e-04 | -5.178117049725595e-14 | -3.698655035518282e-01 | PASS |
| foss_mpi_omp_autotools: [foss2023a-mpi] | 5.517961618368916e-04 | -2.128028656067649e-14 | -1.520020468619749e-01 | PASS |
| foss_valgrind_autotools: [foss2023a-serial] | 5.517961618818336e-04 | 2.366173663254090e-14 | 1.690124045181493e-01 | PASS |
| foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] | 5.517961618757059e-04 | 1.753404279408732e-14 | 1.252431628149094e-01 | PASS |